ethyl 3-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]-5-chloranyl-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]-5-chloranyl-1H-indole-2-carboxylate Openeye Name: ethyl 5-chloro-3-[2-(1,3-dioxoisoindolin-2-yl)ethyl]-1H-indole-2-carboxylate CAS Name: 5-chloro-3-[2-(1,3-dioxo-2-isoindolyl)ethyl]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-3-[2-(1,3-dioxoisoindol-2-yl)ethyl]-1H-indole-2-carboxylate Traditional Name: 5-chloro-3-(2-phthalimidoethyl)-1H-indole-2-carboxylic acid ethyl ester Formula: C21H17ClN2O4 MolecularWeight: 396.82368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)Cl)CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)Cl)CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H17ClN2O4/c1-2-28-21(27)18-13(16-11-12(22)7-8-17(16)23-18)9-10-24-19(25)14-5-3-4-6-15(14)20(24)26/h3-8,11,23H,2,9-10H2,1H3